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Henry Chermette
Affiliation : Lyon 1 Université · Centre National de la Recherche Scientifique · Université de Lyon · Institut des Sciences Analytiques
- 49Publications (affiliation in France)
- 415Total publications
- 8244Citations
- 41h-index
Research profile
Henry Chermette has 49 indexed publications (1997–2026). Their work appears mainly in “New Journal of Chemistry”, “Molecular Physics” and “Theoretical Chemistry Accounts”. Their most cited article, “Photocatalytic decolorization of Remazol Black 5 (RB5) and Procion Red MX-5B—Isotherm of adsorption, kinetic of decolorization and mineraliz” (2007), has been cited 120 times. 13 of these publications date from the last three years of activity. Their work is co-authored with at least 12 researchers, including institutions in Tunisia, Algeria.
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Create my free profile Add my publicationsResearch areas
- Advanced Chemical Physics Studies
- Chemical Reaction Mechanisms
- Advanced Physical and Chemical Molecular Interactions
- Crystallography and molecular interactions
- Spectroscopy and Quantum Chemical Studies
Publications (49)
- DFT investigation of the antioxidant mechanisms of heavy Chalcogen (S, Se, Te) derivatives of Chrysin
- Structural, linear, and nonlinear optical properties of ortho -carboranyl luminophores: insights from DFT and TD-DFT studies
- New sensors based on DNA base pairs: DFT, QTAIM, and NCI-RDG study
- Electronic and optical properties of copper nanostructures for advanced applications
- Predicting and controlling the second-order NLO response in a new class of multi-decker sandwich clusters {µ-B2H2S2Pd(Cl)2}-(CoCp) n, (n = 2 to 5)
- Investigation of free radical scavenging activities of some Isatin Schiff bases (OH versus NH). A DFT Study
- In Silico Study: DFT / TDDFT /Admet and Molecular Docking, of Some Phytochemical Components of Plants Widely Used for the Treatment of COVID‐19
- Synthesis, Characterisation, Hirshfeld Surface Analysis, Magnetic Susceptibility, DFT Calculations, pkCSM Profile, and Biological Activities of Novel Mono‐, Di‐, and Multinuclear Cobalt (II) Complexes
- Understanding the second and third order nonlinear optical responses of M@b 66/64 Al 12 N 12 : a comprehensive DFT and TD-DFT study
- DFT and Docking Calculations of the Structural, Electronic, Biological and Conductivity Properties of the Synthetic Complex [Cu(hfac) 2 (L) 2 ][PF 6 ] 2
- Prediction by DFT and Docking Calculations of a Series of Hypothetical 3d Transition Element Isostructural Complexes [M(hfac) 2 (TTF) 2 ]: A Comparative Study
- Axial/Peripheral Halogen‐Substituted Phenoxy Boron Subphthalocyanines for Application as Electron Acceptors Materials for Organic Solar Cells and Hole Transport Materials for Perovskite Solar Cells: A DFT Approach
- Unveiling the mechanism and regioselectivity of the [3 + 2] cycloaddition reaction between N-methylphenylnitrone and 1-sulphonyl-1-trifluoromethylallene. A MEDT study
- The effect of resonance-assisted hydrogen bond on the second-order nonlinear optical properties of pyridine hydrazone photoswitches: a quantum chemistry investigation
- Predicting the activity of methoxyphenol derivatives antioxidants: II —Importance of the nature of the solvent on the mechanism, a DFT study
- Degradation by hydrolysis of three triphenylmethane dyes: DFT and TD-DFT study
- Predicting the activity of methoxyphenol derivatives antioxidants: I. Structure and reactivity of methoxyphenol derivatives, a DFT approach
- Understanding the mechanism and regio‐ and stereo selectivity of [3 + 2] cycloaddition reactions between substituted azomethine ylide and 3,3,3‐ trifluoro ‐1‐nitroprop‐1‐ene, within the molecular electron density theory
- DFT study of the condensation products of 2-chloro-3-formylquinolines with o-aminophenol, o-aminothiophenol and o-phenylenediamine
- Bis-TTF-Ge derivatives: promising linear and nonlinear optical properties, a theoretical investigation
- Combined experimental, computational studies (synthesis, crystal structural, DFT calculations, spectral analysis) and biological evaluation of the new homonuclear complex Di-µ-benzoato-bis [benzoatodipyridine-cobalt (II)]
- Structural, Electronic, Thermodynamic, Optical and Nonlinear Optical Properties of Curcumin Complexes with Transition Metals: DFT and TD‐DFT Study
- Reactivity and a Charge-Transfer Model Analysis in Aminopolycarboxylic–Metal Complexes
- Correlation between Second Ionization Potential and Nonlinear Optical Properties of Bivalent Transition-Metal Complexes: A Quantum Chemical Study
- Exploring the antioxidant activity of thiaflavan compounds: a quantum chemical study
- A computational investigation of the selectivity and mechanism of the Lewis acid catalyzed oxa‐Diels–Alder cycloaddition of substituted diene with benzaldehyde
- Predicted structure and selectivity of 3d transition metal complexes with glutamic N , N -bis(carboxymethyl) acid
- Optical and nonlinear optical properties of Ln(Tp) 2 , where Ln = La,…,Lu and Tp = tris(pyrazolyl)borate: a DFT+TD-DFT study
- Theoretical study of the mechanism and regioselectivity in the formation of pyrazolo[1,5-a]-[1,3,5]-triazines and pyrazolo[1,5-a]-[1,3,5]triazinones: A DFT study
- Substituent Effect on the Himbert Intramolecular Arene/Allene Diels–Alder Reaction: NBO Analysis and State Specific Dual Descriptors
- Relaxation of Kohn–Sham orbitals of organometallic complexes during the approach of a nucleophilic reactant (or an electron approach): the case of [sal(ph)en]2 Zn complexes
- Coordination chemistry of Zn2+with Sal(ph)en ligands: Tetrahedral coordination or penta‐coordination? a DFT analysis
- Fluorine substituent effect on the stereochemistry of catalyzed and non-catalyzed Diels–Alder reactions. The case of R-butenone with cyclopentadiene: a computational assessment of the mechanism
- Unexpected Structure of a Helical N4‐Schiff‐Base Zn(II) Complex and Its Demetallation: Experimental and Theoretical Studies
- Combined QTAIM and ETS-NOCV investigation of the interactions in ClnM[PhB(NtBu)2] complexes with M = Si & Ge (n = 0), As & Sb (n = 1), Te & Po (n = 2)
- DFT study of isomers of the ruthenium dihydride complex RuH2(CO)2(AsMe2Ph)2
- Ill-advised self-interaction contribution in modelling anionic attack along a reaction path
- Theoretical investigation on two different mechanisms of fulleropyrrolidine formation
- Allylation of active methylene compounds with cyclic Baylis–Hillman alcohols: a DFT study
- Addition–fragmentation reaction of thionoesters compounds in free-radical polymerisation (methyl, cyanomethyl and styryl): a theoretical interpretation
- Mechanism of addition-fragmentation reaction of thiocarbonyls compounds in free radical polymerization. A DFT study
- DFT study of the stereo-selectivity of oxygenated heterocycles from 10 to 12 links
- A quantum chemistry investigation on the structure of lanthanide triflates Ln(OTf)3 where Ln = La, Ce, Nd, Eu, Gd, Er, Yb and Lu
- Photocatalytic decolorization of Remazol Black 5 (RB5) and Procion Red MX-5B—Isotherm of adsorption, kinetic of decolorization and mineralization
- Interaction of lead atom with atmospheric dioxygen and ozone: Quantic study of the structure and the stability of resulting Pb(On) (n=1,2,3) compounds
- Ab initioand density functional theory study of lead complexes of atmospheric interest Pb(H2), Pb(OH), Pb(H2O), Pb(HO2) and Pb(OH)2
- Interaction of lead atom with atmospheric hydroxyl radical. An ab initio and density functional theory study of the resulting complexes PbOH and HPbO
- Electronic structure and molecular spectroscopic constants of ScN and ScP investigated by several quantum chemistry methods
- Electrical properties of molybdenum disulfide MoS2. Experimental study and density functional calculation results
Publication venues
- New Journal of Chemistry × 7
- Molecular Physics × 5
- Theoretical Chemistry Accounts × 5
- ChemistrySelect × 4
- Journal of Computational Chemistry × 4
- Computational and Theoretical Chemistry × 3
Publications per year
- 20262
- 20255
- 20246
- 20236
- 20224
- 20214
- 20194
- 20184
- 20171
- 20162
Collaborations
Partner institutions : Institut de Recherches sur la Catalyse et l'Environnement de Lyon · École Normale Supérieure de Lyon · Tunis El Manar University · Ingenierie des Materiaux polymeres · Institut des Sciences Chimiques de Rennes
Co-authors’ countries : Tunisia · Algeria
Co-authors
- Christophe Morell
- Lynda Merzoud
- Lorraine Christ
- Guillaume Hoffmann
- Walid Lamine
- Michel Arotçaréna
- Stéphane Golhen
- François Rogemond
- F. Rogemond
- E. Jeanneau
- Philippe R. Chaumont
- Karima Sahel
Bibliographic data from OpenAlex (open database).
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